2-Propenoic acid, 3-bromo-, ethyl ester, (2Z)-


Chemical Name: 2-Propenoic acid, 3-bromo-, ethyl ester, (2Z)-
CAS Number: 31930-34-4
Product Number: AG003QEM(AGN-PC-0O8VCW)
Synonyms:
MDL No:
Molecular Formula: C5H7BrO2
Molecular Weight: 179.01188

Identification/Properties


Properties
BP:
75 °C (12 mmHg)
Storage:
Inert atmosphere;2-8℃;
Form:
Liquid
Refractive Index:
n20/D 1.481
Computed Properties
Molecular Weight:
179.013g/mol
XLogP3:
1.4
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
2
Rotatable Bond Count:
3
Exact Mass:
177.963g/mol
Monoisotopic Mass:
177.963g/mol
Topological Polar Surface Area:
26.3A^2
Heavy Atom Count:
8
Formal Charge:
0
Complexity:
98.6
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
Undefined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
1
Compound Is Canonicalized:
Yes

Safety Information


NMR Spectrum


Other Analytical Data


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